Tert-butyl propaneperoxoate
TL;DR: Tert-butyl propaneperoxoate (CAS 14206-05-4) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl propaneperoxoate
Also Known As: tert-butyl propaneperoxoate, tert-butylpropaneperoxoate, Perpropionic acid tert-butyl ester, Peroxypropionic acid tert-butyl ester, Propaneperoxoic acid tert-butyl ester
| Molecular Formula | C7H14O3 |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.0943 |
| Heavy Atoms | 10 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 14206-05-4 |
|---|---|
| SMILES | CCC(=O)OOC(C)(C)C |
| InChIKey | BBXFLQCFPROIMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tert-butyl propaneperoxoate (CAS 14206-05-4), with molecular formula C7H14O3 and molecular weight 146.09 g/mol. IUPAC: tert-butyl propaneperoxoate.
Chemical Property Profile of Tert-butyl propaneperoxoate
Property Insights of Tert-butyl propaneperoxoate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tert-butyl propaneperoxoate. With a topological polar surface area (TPSA) of 35.5 Ų, Tert-butyl propaneperoxoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl propaneperoxoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tert-butyl propaneperoxoate?
The CAS number of Tert-butyl propaneperoxoate is 14206-05-4.
What is the molecular formula of Tert-butyl propaneperoxoate?
The molecular formula of Tert-butyl propaneperoxoate is C7H14O3.
What is the molecular weight of Tert-butyl propaneperoxoate?
The molecular weight of Tert-butyl propaneperoxoate is 146.09 g/mol.
Where can I buy Tert-butyl propaneperoxoate?
You can request a quote for Tert-butyl propaneperoxoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tert-butyl propaneperoxoate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl propaneperoxoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.